M177-0307 Screening compound: propan-2-yl 2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}acetate

M177-0307 Screening compound: propan-2-yl 2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}acetate
M177-0307 Screening compound: propan-2-yl 2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound M177-0307
propan-2-yl 2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}acetate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

M177-0307

Molecular Formula

C19H16ClN5O4 (C19 H16 ClN5 O4)

Compound Name

propan-2-yl 2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}acetate

IUPAC name

propan-2-yl 2-{8-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]-3-oxo-2H3H-[124]triazolo[43-a]pyridin-2-yl}acetate

SMILES

CC(C)OC(CN1N=C(C(c2nc(-c(cc3)ccc3Cl)no2)=CC=C2)N2C1=O)=O

InChI

InChI=1S/C19H16ClN5O4/c1-11(2)28-15(26)10-25-19(27)24-9-3-4-14(17(24)22-25)18-21-16(23-29-18)12-5-7-13(20)8-6-12/h3-9,11H,10H2,1-2H3

InChI Key

HWCZJXROTRVVRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22592229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.82

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.585

Distribution Coefficient, logD

3.585

Water Solubility, LogSw

-3.99

Polar Surface Area

82.816

Acid Dissociation Constant (pKa)

18.93

Base Dissociation Constant (pKb)

3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

M177-0307 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Inflammatory Library (24602 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M177-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M177-0307?
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What is the minimum amount of M177-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M177-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M177-0307
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of M177-0307 available by request